2′,5′-Diethoxybenzanilide - ≥97% , CAS No.92-22-8

CAS: 92-22-8 Cat. No.: D338198 Peso molecular: 285.33 Número EC: 202-137-3

GRADE & PURITY ≥97%

Synonyms

Benzamide, N-(2,5-diethoxyphenyl)- | MFCD00026798 | MRB0DWF9G1 | NSC163154 | NSC-163154 | FT-0631446 | n-(2,5-diethoxyphenyl)benzamide | EINECS 202-137-3 | Z28860058 | AKOS001315927 | SCHEMBL1756430 | DTXSID90238815 | NSC 163154 | Benzamide,N-(2,5-diethox

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

Benzamide, N-(2, 5-diethoxyphenyl)- | MFCD00026798 | MRB0DWF9G1 | NSC163154 | NSC-163154 | FT-0631446 | n-(2, 5-diethoxyphenyl)benzamide | EINECS 202-137-3 | Z28860058 | AKOS001315927 | SCHEMBL1756430 | DTXSID90238815 | NSC 163154 | Benzamide, N-(2, 5-diethox

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 504754085
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504754085
• Sonrisas canónicas: CCOC1=CC(=C(C=C1)OCC)NC(=O)C2=CC=CC=C2
• IUPAC Name: N-(2,5-diethoxyphenyl)benzamide
• InChIKey: OEZDYMAFWLGKFC-UHFFFAOYSA-N
• INCHI: 1S/C17H19NO3/c1-3-20-14-10-11-16(21-4-2)15(12-14)18-17(19)13-8-6-5-7-9-13/h5-12H,3-4H2,1-2H3,(H,18,19)
• Isómeros SMILES: CCOC1=CC(=C(C=C1)OCC)NC(=O)C2=CC=CC=C2
• Peso molecular: 285.33
• Reaxy-Rn: 3392837
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3392837&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Anilides
        • Level5 Aromatic anilides
          • Level6 Benzanilides

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Anilides
• Intermediate Tree Nodes: Aromatic anilides
• Direct Parent: Benzanilides
• Alternative Parents: Benzamides Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers Secondary carboxylic acid amides Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzanilide - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - Phenol ether - Alkyl aryl ether - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as benzanilides. These are aromatic compounds containing an anilide group in which the carboxamide group is substituted with a benzene ring. They have the general structure RNC(=O)R', where R,R'= benzene.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Peso molecular: 285.340 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 285.136 Da
• Monoisotopic Mass: 285.136 Da
• Topological Polar Surface Area: 47.600 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 315.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1